4-(2,4-dichlorophenyl)-1H-1,5-benzodiazepine-2-carboxylic acid

Systemtic Name: 4-(2,4-dichlorophenyl)-1H-1,5-benzodiazepine-2-carboxylic acid Openeye Name: 4-(2,4-dichlorophenyl)-1H-1,5-benzodiazepine-2-carboxylic acid CAS Name: 4-(2,4-dichlorophenyl)-1H-1,5-benzodiazepine-2-carboxylic acid IUPAC Name: 4-(2,4-dichlorophenyl)-1H-1,5-benzodiazepine-2-carboxylic acid Traditional Name: 4-(2,4-dichlorophenyl)-1H-1,5-benzodiazepine-2-carboxylic acid Formula: C16H10Cl2N2O2 MolecularWeight: 333.1688

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=CC(=N2)C3=C(C=C(C=C3)Cl)Cl)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)NC(=CC(=N2)C3=C(C=C(C=C3)Cl)Cl)C(=O)O

InChI

InChI=1S/C16H10Cl2N2O2/c17-9-5-6-10(11(18)7-9)14-8-15(16(21)22)20-13-4-2-1-3-12(13)19-14/h1-8,20H,(H,21,22)